CC1=C(C#N)C(=C(C#N)C#N)OC1(c1ccccc1)C(F)(F)F
Name: 2-(3-cyano-4-methyl-5-phenyl-5-trifluoromethyl-2(5H)-furanylidene)propanedinitrile
SMILES: CC1=C(C#N)C(=C(C#N)C#N)OC1(c1ccccc1)C(F)(F)F

Molecular Processing

Molecular formula
C16H8F3N3O
Molecular weight
315.25
Exact mass
315.0619
XLogP
3.62
TPSA
80.6
H-bond donors
0
H-bond acceptors
4
Rotatable bonds
1
Heavy atoms
23
Rings
2
Aromatic rings
1
Saturated rings
0
Aliphatic rings
1
Stereo centers
1
Undefined stereo
1
Formal charge
0
Heteroatoms
7
Covalent units
1
Fraction Csp3
0.188
Molar refractivity
71.83

Supplementary Information

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